In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 16 | Yes |
Popular Name: 6-(aminomethyl)-N-methyl-N-(3-thienylmethyl)pyridin-2-amine 6-(aminomethyl)-N-methyl-N-(3-th…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.38 | 5.27 | -44.2 | 3 | 3 | 1 | 44 | 234.348 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 4.87 | -5.76 | 2 | 3 | 0 | 42 | 233.34 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 4.94 | -27.2 | 3 | 3 | 1 | 43 | 234.348 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 5.33 | -106.27 | 4 | 3 | 2 | 45 | 235.356 | 4 | ↓ |